1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-{[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-{[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl}-1H-pyrrole-3-carboxylic acid
1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-{[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-1299 |
| Compound Name: | 1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-{[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl}-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 440.94 |
| Molecular Formula: | C25 H26 Cl F N2 O2 |
| Smiles: | Cc1c(CNC2CCCc3ccccc23)c(C(O)=O)c(C)n1Cc1c(cccc1[Cl])F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0479 |
| logD: | 5.0479 |
| logSw: | -4.802 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.744 |
| InChI Key: | CZUOJOUUMIDIND-QHCPKHFHSA-N |